0 mol 59 unq 0 iso 0 dist 6.47132 10.6275 6.48625 13.108 6.8958 5.70814 numMergedOcc 0
1 mol 59 unq 1 iso 0 dist 6.47132 10.6275 6.48625 11.9493 5.85228 5.58384 numMergedOcc 0
2 mol 102 unq 0 iso 0 dist 5.79411 6.82817 9.01767 11.1701 8.58092 8.07962 numMergedOcc 0
3 mol 102 unq 1 iso 0 dist 5.79411 6.82817 9.01767 13.3808 12.5781 7.58908 numMergedOcc 0
4 mol 102 unq 2 iso 0 dist 5.79411 10.6581 9.80678 11.1701 8.58092 9.54857 numMergedOcc 0
5 mol 102 unq 3 iso 0 dist 5.79411 10.6581 9.80678 13.3808 12.5781 9.32058 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 8.98848 14.6332 9.85576 21.57 13.5681 9.33403 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 6.1421 7.55004 6.29026 11.3542 5.56946 8.63018 numMergedOcc 0
8 mol 129 unq 1 iso 0 dist 9.54663 8.10347 6.29026 13.9359 5.56946 8.63018 numMergedOcc 0
9 mol 147 unq 0 iso 0 dist 9.11046 4.02727 9.18866 8.94007 6.91778 6.00651 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 9.00273 17.3985 8.64255 20.8152 13.0113 5.79753 numMergedOcc 0
11 mol 197 unq 1 iso 0 dist 9.00273 17.3985 8.64255 11.6782 4.57437 7.56537 numMergedOcc 0
12 mol 197 unq 2 iso 0 dist 7.19387 14.5201 8.64255 19.6096 13.0113 5.79753 numMergedOcc 0
13 mol 197 unq 3 iso 0 dist 7.19387 14.5201 8.64255 10.1866 4.57437 7.56537 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 9.5181 7.03383 8.47009 6.28725 6.94762 9.36753 numMergedOcc 0
15 mol 257 unq 0 iso 0 dist 8.99981 5.42185 4.97263 10.7566 4.37426 8.43067 numMergedOcc 0
16 mol 257 unq 1 iso 0 dist 8.99981 5.42185 4.97263 11.6346 5.03065 7.6127 numMergedOcc 0
17 mol 257 unq 2 iso 0 dist 6.50405 5.42185 5.36776 10.7566 5.8531 8.43067 numMergedOcc 0
18 mol 257 unq 3 iso 0 dist 6.50405 5.42185 5.36776 11.6346 5.98419 7.6127 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 9.89728 16.8866 7.93997 12.4734 5.41945 5.22111 numMergedOcc 0
20 mol 259 unq 1 iso 0 dist 9.89728 16.8866 7.93997 14.3197 10.2837 8.53598 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 5.37894 5.44615 6.60309 6.92426 5.58906 7.52227 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 8.62414 18.1946 9.82774 22.0836 13.5373 6.83278 numMergedOcc 0
